Geometry & MOs

Info

ID:	39213
PubChem CID:	8139926
Reduced:	O2N3C19H21 (1)
Stoich.:	A2B3C19D21 (1)
Weight, g/mol:	358.072035
ΔH_f, kcal/mol:	-0.59
Dipole, Da:	9.88
IP(EA), eV:	-9.16(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(3-methylphenoxy)acetate

Drug info:

PubChemData

Smile

CN(C)CC1=CC=CC=C1CNC(=O)COC2=CC=CC=C2C#N

DOS

IR

Vibrations